| SpectraBase Compound ID | IU4xi5VnEEb |
|---|---|
| InChI | InChI=1S/C44H70O14/c1-22-31(49)36(58-37-34(52)33(51)32(50)26(56-37)19-54-23(2)47)35(53)38(55-22)57-30-12-13-40(5)27(41(30,6)20-45)11-14-42(7)28(40)10-9-24-25-17-39(3,4)15-16-44(25,21-46)29(48)18-43(24,42)8/h9-10,22,26-38,45-46,48-53H,11-21H2,1-8H3/t22-,26-,27?,28?,29-,30+,31+,32-,33+,34-,35-,36+,37+,38-,40+,41+,42-,43-,44-/m1/s1 |
| InChIKey | JVVGHTDCSIJQTI-SPDFCRHJSA-N |
| Mol Weight | 823.0 g/mol |
| Molecular Formula | C44H70O14 |
| Exact Mass | 822.476557 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 4CfJjjDmaMj |
|---|---|
| Name | JVVGHTDCSIJQTI-SPDFCRHJSA-N |
| Compound Number | 26 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C44H70O14 |
| InChI | InChI=1S/C44H70O14/c1-22-31(49)36(58-37-34(52)33(51)32(50)26(56-37)19-54-23(2)47)35(53)38(55-22)57-30-12-13-40(5)27(41(30,6)20-45)11-14-42(7)28(40)10-9-24-25-17-39(3,4)15-16-44(25,21-46)29(48)18-43(24,42)8/h9-10,22,26-38,45-46,48-53H,11-21H2,1-8H3/t22-,26-,27?,28?,29-,30+,31+,32-,33+,34-,35-,36+,37+,38-,40+,41+,42-,43-,44-/m1/s1 |
| InChIKey | JVVGHTDCSIJQTI-SPDFCRHJSA-N |
| Literature Reference Author | J.-K.DING,H.FUJINO,R.KASAI,N.FUJIMOTO,O.TANAKA,J.ZHOU,H.MATS UURA,T.FUWA |
| Literature Reference Citation | CHEM.PHARM.BULL.,34,1158(1986) |
| Literature Reference DOI | 10.1248/cpb.34.1158 |
| Molecular Weight | 823.031 g/mol |
| Solvent | PYRIDINE-D5 |
| Source File Reference | UWBK185 |